Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL5762132

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
Cn1nccc1Nc1nccc(-c2cc3n4c(nnc4c2)[C@H](Cc2ccccc2)CN3)n1

Basic Information

ChEMBL ID CHEMBL5762132
Phase Preclinical
Structure Type MOL
InChI Key BANNDVQQTGYFLM-QGZVFWFLSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

423.5
MW (Da)
3.42
ALogP
9
HBA
2
HBD
97.8
PSA (Ų)
0.45
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H21N9
MW 423.48
Aromatic Rings 5
Heavy Atoms 32
NP-Likeness -1.31

Activity Summary

IC50 2 meas. best 9.42

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Mitogen-activated protein kinase 1
CHEMBL4040
IC50 9.42 9.42 0.4 1
Mitogen-activated protein kinase 6
CHEMBL5121
IC50 9.42 9.42 0.4 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine